Franke, R.; Gruska, A.; Giuliani, A.; Benigni, R. Prediction of rodent carcinogenicity of aromatic amines: a quantitative structure-activity relationships model. Carcinogenesis 2001, 22, 1561–1571.

Compound

	ID:	44
	Name:	2,4-Diaminophenol dihydrochloride
	Description:	Changed name from the original 2,4-Diaminophenol · 2HCl to 2,4-Diaminophenol dihydrochloride. The authors most likely used the cation for the calculations.
	Labels:
	CAS:	137-09-7
	InChi Code:	InChI=1S/C6H8N2O.2ClH/c7-4-1-2-6(9)5(8)3-4;;/h1-3,9H,7-8H2;2*1H

Properties

Carcinogenicity: Class: C - Carcinogenic, nC -non-Carcinogenic

Value	Source or prediction
C	experimental value
C	Eq.5: Carcinogenic class of aromatic amines (Training set.)

Potency: Carcinogenic potency as log(MW/TD50) [log((mol/kg)/TD50)]

Value	Source or prediction
29.285568	experimental value

Links to External Resources

Link	Resource description
DTXSID9020401	US EPA CompTox Dashboard